SCHEMBL619840

SCHEMBL619840

COC(C)CC/C=C(\C)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX15 P16050 3/20 0.36
CD81 P60033 2/20 0.34
ACLY P53396 1/20 0.33
ACACA Q13085 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.32
PPARG P37231 1/20 0.31
FAAH O00519 1/20 0.30
KDM1A O60341 1/20 0.30
MEN1 O00255 1/20 0.30
PLA2G1B P04054 1/20 0.30
MAPT P10636 1/20 0.30
DNMT1 P26358 1/20 0.30
BLM P54132 1/20 0.30
KMT2A Q03164 1/20 0.30
ATG4B Q9Y4P1 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL388924 1.00 CYP2D6 (0.38) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL553718 0.83 CYP2D6 (0.37) CYP2D6CYP2C19ALOX15ALDH1A1TSHR
SCHEMBL553720 0.83 CYP2D6 (0.37) CYP2D6CYP2C19ALOX15ALDH1A1TSHR
SCHEMBL3934005 0.82 CYP2D6 (0.39) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL3934007 0.82 CYP2D6 (0.39) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL14151457 0.81 CYP2D6 (0.36) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL11341491 0.81 CYP2D6 (0.41) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL2115176 0.80 ALOX15 (0.33) CYP2D6CYP2C19ALOX15CD81ACLY
SCHEMBL828377 0.80 APEX1 (0.31)
SCHEMBL3429210 0.80 APEX1 (0.31)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 67 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3847220-B1 UV-CURABLE HOT MELT ADHESIVE COMPOSITIONS FOR FLOORING APPLICATIONS BASF SE (DE) 2025-03-05 EP claimed
EP-3204444-B1 PHOSPHATE ESTER-MODIFIED ACRYLIC POLYOLS BASF SE (DE) 2023-08-30 EP claimed
EP-1529787-B1 Rosin-fatty acid ester vinylic polymers MEADWESTVACO CORP (US) 2006-03-15 EP claimed
EP-1215221-B1 Rosin-fatty acid vinylic emulsion compositions MEADWESTVACO CORP (US) 2004-08-11 EP claimed
EP-0994123-B1 Rosin-fatty acid vinylic polymer compositions WESTVACO CORP (US) 2004-06-30 EP claimed
US-11560517-B2 Photoreactive liquid crystal composition, display element, optical element, method for manufacturing display element, and method for manufacturing optical element UNIVERSITY OF HYOGO (JP) 2023-01-24 US disclosed
EP-3642284-B1 CURABLE ORGANOPOLYSILOXANE COMPOSITIONS WACKER CHEMIE AG (DE) 2022-06-01 EP disclosed
US-20200332194-A1 PHOTOREACTIVE LIQUID CRYSTAL COMPOSITION, DISPLAY ELEMENT, OPTICAL ELEMENT, METHOD FOR MANUFACTURING DISPLAY ELEMENT, AND METHOD FOR MANUFACTURING OPTICAL ELEMENT UNIVERSITY OF HYOGO (JP) 2020-10-22 US disclosed
EP-2700394-B1 Use of a solvent-free adhesion promoter to create an adhesive bond between dental composites and the surface of dental frameworks made of high-performance polymers KULZER & CO GMBH (DE) 2020-09-09 EP disclosed
EP-3642284-A1 CURABLE ORGANOPOLYSILOXANE COMPOSITIONS Wacker Chemie AG (DE) 2020-04-29 EP disclosed
WO-2019052660-A1 CURABLE ORGANOPOLYSILOXANE COMPOSITIONS WACKER CHEMIE AG (DE) 2019-03-21 WO disclosed
EP-2113237-B1 Dental materials with anti-plaque agents HERAEUS KULZER GMBH (DE) 2014-12-10 EP disclosed
EP-0508095-A2 Dental materials based on (meth)-acrylates Heraeus Kulzer GmbH & Co.KG (DE) 1992-10-14 EP disclosed
EP-0499099-A1 Receiving element for a thermosublimation process Agfa-Gevaert AG (DE) 1992-08-19 EP disclosed
EP-0497157-A2 Crosslinked molded dental articles Heraeus Kulzer GmbH & Co.KG (DE) 1992-08-05 EP disclosed
EP-0452696-A2 Aqueous solutions or dispersions of hydroxy-functionalized copolymers, process for their manufacture and use thereof BAYER AG (DE) 1991-10-23 EP disclosed
EP-0442326-A2 Filler containing swellable bead polymers BAYER AG (DE) 1991-08-21 EP disclosed
EP-0401627-A2 Copolymers with hydroxy groups, process for their preparation and their usage as binder BAYER AG (DE) 1990-12-12 EP disclosed
EP-0346707-A2 Dental materials BAYER AG (DE) 1989-12-20 EP disclosed
EP-0346708-A2 Fillers BAYER AG (DE) 1989-12-20 EP disclosed